COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK620526
Chemical Name: (2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl2-bromobenzoate
Smiles: O=C1/C(=C/c2ccc3c(c2)OCO3)/Oc2c1ccc(c2)OC(=O)c1ccccc1Br

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Molecular Weight: 465.26
Empirical Formula: C23H13BrO6

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.37
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 71
Number of rings: 5

     

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